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snRNA-activating protein complex subunit 5

Part of the SNAPc complex required for the transcription of both RNA polymerase II and III small-nuclear RNA genes. Binds to the proximal sequence element (PSE), a non-TATA-box basal promoter element common to these 2 types of genes. Recruits TBP and BRF2 to the U6 snRNA TATA box.

AlphaFold DB , UniProt , Accession O75971, Species HUMAN (Homo sapiens, Human), Gene SNAPC5, Length 98 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M82Confident95.3Very high214 Ų214121.5 Ų121.5100%1.05458%0.575SS**  0-51.30-95.7-172.8-78.800113.1S3 R4 L5M1-S3 PolarHBondContact O-N 2.84Å; M1-R4 PolarHBondContact O-N 3.09Å; M1-R4 VanDerWaalsContact O-N 3.16Å; M1-L5 PolarHBondContact O-N 3.46Å; M1-L5 VanDerWaalsContact O-N 3.13Å
2L91.2Very high95.5Very high119 Ų119121.3 Ų121.362%0.62357%0.574SS**Hα-helixtrans-55.5-43.6-176.8-172.764.7000113.9R4 L5 Q6L2-R4 PolarHBondContact O-N 2.97Å; L2-L5 PolarHBondContact O-N 2.78Å; L2-Q6 WeakPolarHBondContact O-CG 3.3Å; L2-Q6 PolarHBondContact O-N 2.85Å
3S95.3Very high95.7Very high76 Ų76119.5 Ų119.553%0.53157%0.565SS.*Hα-helixtrans-60-44.4177.7-41.50000112.4M1 L5 Q6 E7M1-S3 PolarHBondContact O-N 2.84Å; S3-L5 VanDerWaalsContact C-N 3.29Å; S3-L5 PolarHBondContact O-N 2.96Å; S3-Q6 WeakPolarHBondContact O-CB 3.19Å; S3-Q6 PolarHBondContact O-N 3.12Å; S3-Q6 VanDerWaalsContact O-N 3.14Å; S3-E7 WeakPolarHBondContact O-CG 3.43Å; S3-E7 PolarHBondContact O-N 3.48Å
4R96.1Very high95.9Very high150 Ų150115.7 Ų115.757%0.56655%0.553SS**Hα-helixtrans-61.9-38.3177.3-177.357.5175-167.82.4112M1 L2 E7 L8M1-R4 PolarHBondContact O-N 3.09Å; M1-R4 VanDerWaalsContact O-N 3.16Å; L2-R4 PolarHBondContact O-N 2.97Å; R4-E7 IonicContact NH1-OE2 3.74Å; R4-E7 PolarHBondContact O-N 3.41Å; R4-L8 HydrophobicContact CG-CD1 4.32Å; R4-L8 WeakPolarHBondContact O-CG 3.5Å; R4-L8 PolarHBondContact O-N 3.28Å
5L97.4Very high96.1Very high96 Ų96114.8 Ų114.850%0.50355%0.552SS.*Hα-helixtrans-70-33.8177.2-168.5135.1000112M1 L2 S3 R9M1-L5 PolarHBondContact O-N 3.46Å; M1-L5 VanDerWaalsContact O-N 3.13Å; L2-L5 PolarHBondContact O-N 2.78Å; S3-L5 VanDerWaalsContact C-N 3.29Å; S3-L5 PolarHBondContact O-N 2.96Å; L5-R9 WeakPolarHBondContact O-CB 3.27Å; L5-R9 PolarHBondContact O-N 3.46Å; L5-R9 VanDerWaalsContact O-N 3.12Å
6Q97.6Very high96.3Very high98 Ų98114.1 Ų114.146%0.45855%0.551SS.*Hα-helixtrans-69.3-40172.8-70.9174-23.200112.2L2 S3 R9 K10L2-Q6 WeakPolarHBondContact O-CG 3.3Å; L2-Q6 PolarHBondContact O-N 2.85Å; S3-Q6 WeakPolarHBondContact O-CB 3.19Å; S3-Q6 PolarHBondContact O-N 3.12Å; S3-Q6 VanDerWaalsContact O-N 3.14Å; Q6-R9 PolarHBondContact O-N 2.77Å; Q6-K10 WeakPolarHBondContact O-CG 3.41Å; Q6-K10 PolarHBondContact O-N 3.43Å; Q6-K10 VanDerWaalsContact O-N 3.1Å
7E97.4Very high96.4Very high101 Ų101116.4 Ų116.447%0.47255%0.553SS.*Hα-helixtrans-59.7-51.6173.2-73.6163.2-158.100111.2S3 R4 R9 K10 E11S3-E7 WeakPolarHBondContact O-CG 3.43Å; S3-E7 PolarHBondContact O-N 3.48Å; R4-E7 IonicContact NH1-OE2 3.74Å; R4-E7 PolarHBondContact O-N 3.41Å; E7-R9 VanDerWaalsContact C-N 3.27Å; E7-R9 PolarHBondContact O-N 3.29Å; E7-K10 WeakPolarHBondContact O-CB 3.46Å; E7-K10 PolarHBondContact O-N 3.2Å; E7-K10 VanDerWaalsContact O-N 3.09Å; E7-E11 PolarHBondContact O-N 3.47Å
8L98.1Very high96.5Very high85 Ų85115.8 Ų115.845%0.44555%0.553SS.*Hα-helixtrans-58.8-38.4178.9-73.7171.4000112.3R4 E11 E12R4-L8 HydrophobicContact CG-CD1 4.32Å; R4-L8 WeakPolarHBondContact O-CG 3.5Å; R4-L8 PolarHBondContact O-N 3.28Å; L8-E11 PolarHBondContact O-N 3.28Å; L8-E12 WeakPolarHBondContact O-CB 3.21Å; L8-E12 PolarHBondContact O-N 2.89Å
9R97.2Very high96.7Very high152 Ų152117.5 Ų117.557%0.57456%0.558SS**Hα-helixtrans-64.7-42175.8-170.2-171.2-53.4173.72112.3L5 Q6 E7 E11 E13L5-R9 WeakPolarHBondContact O-CB 3.27Å; L5-R9 PolarHBondContact O-N 3.46Å; L5-R9 VanDerWaalsContact O-N 3.12Å; Q6-R9 PolarHBondContact O-N 2.77Å; E7-R9 VanDerWaalsContact C-N 3.27Å; E7-R9 PolarHBondContact O-N 3.29Å; R9-E11 VanDerWaalsContact C-N 3.35Å; R9-E13 WeakPolarHBondContact O-CB 3.46Å; R9-E13 PolarHBondContact O-N 3.16Å
10K97.7Very high96.8Very high143 Ų143114.3 Ų114.362%0.62255%0.552SS**Hα-helixtrans-65-42.7176.2-72175.9179.7-179.40110.7Q6 E7 E13 T14Q6-K10 WeakPolarHBondContact O-CG 3.41Å; Q6-K10 PolarHBondContact O-N 3.43Å; Q6-K10 VanDerWaalsContact O-N 3.1Å; E7-K10 WeakPolarHBondContact O-CB 3.46Å; E7-K10 PolarHBondContact O-N 3.2Å; E7-K10 VanDerWaalsContact O-N 3.09Å; K10-E13 PolarHBondContact O-N 3.24Å; K10-T14 WeakPolarHBondContact O-CG2 3.42Å; K10-T14 PolarHBondContact O-N 3.23Å; K10-T14 PolarHBondContact O-OG1 3.04Å
11E98Very high96.8Very high103 Ų103111.3 Ų111.348%0.48155%0.546SS..Hα-helixtrans-62.3-47.2177.6-171.3173.7-175.200111.3E7 L8 R9 E13 T14 L15E7-E11 PolarHBondContact O-N 3.47Å; L8-E11 PolarHBondContact O-N 3.28Å; R9-E11 VanDerWaalsContact C-N 3.35Å; E11-E13 VanDerWaalsContact C-N 3.33Å; E11-E13 PolarHBondContact O-N 3.42Å; E11-T14 WeakPolarHBondContact CA-OG1 3.4Å; E11-T14 PolarHBondContact O-N 3.07Å; E11-T14 VanDerWaalsContact O-N 3.15Å; E11-T14 PolarHBondContact O-OG1 3.5Å; E11-L15 HydrophobicContact CG-CD1 4.27Å; E11-L15 WeakPolarHBondContact O-CG 3.33Å; E11-L15 PolarHBondContact O-N 2.79Å
12E98.3Very high97.6Very high119 Ų119106.3 Ų106.356%0.55652%0.523SS*.Hα-helixtrans-55.6-46.6174-178.1-177.9-165.200111.7L8 T14 L15 L16L8-E12 WeakPolarHBondContact O-CB 3.21Å; L8-E12 PolarHBondContact O-N 2.89Å; E12-T14 VanDerWaalsContact C-N 3.35Å; E12-T14 PolarHBondContact O-N 3.45Å; E12-L15 PolarHBondContact O-N 3.33Å; E12-L16 HydrophobicContact CG-CD1 4.37Å; E12-L16 WeakPolarHBondContact O-CG 3.38Å; E12-L16 PolarHBondContact O-N 2.89Å
13E98.3Very high98Very high98 Ų98105.7 Ų105.746%0.45852%0.517SS..Hα-helixtrans-60.6-44177-172.9-177.8178.300111.7R9 K10 E11 L16 R17R9-E13 WeakPolarHBondContact O-CB 3.46Å; R9-E13 PolarHBondContact O-N 3.16Å; K10-E13 PolarHBondContact O-N 3.24Å; E11-E13 VanDerWaalsContact C-N 3.33Å; E11-E13 PolarHBondContact O-N 3.42Å; E13-L16 PolarHBondContact O-N 2.96Å; E13-R17 VanDerWaalsContact CD-NH2 3.33Å; E13-R17 WeakPolarHBondContact O-CG 3.38Å; E13-R17 PolarHBondContact O-N 2.89Å; E13-R17 VanDerWaalsContact O-N 3.12Å; E13-R17 IonicContact OE1-CZ 2.78Å; E13-R17 IonicContact OE1-NE 3.99Å; E13-R17 IonicContact OE1-NH2 3.58Å; E13-R17 PolarHBondContact OE1-NH2 2.74Å; E13-R17 IonicContact OE2-NH2 2.65Å
14T98.5Very high98.2Very high66 Ų66107.2 Ų107.241%0.40552%0.519SS..Hα-helixtrans-63.8-41.6176.459.30000111.9K10 E11 E12 L16 R17 L18K10-T14 WeakPolarHBondContact O-CG2 3.42Å; K10-T14 PolarHBondContact O-N 3.23Å; K10-T14 PolarHBondContact O-OG1 3.04Å; E11-T14 WeakPolarHBondContact CA-OG1 3.4Å; E11-T14 PolarHBondContact O-N 3.07Å; E11-T14 VanDerWaalsContact O-N 3.15Å; E11-T14 PolarHBondContact O-OG1 3.5Å; E12-T14 VanDerWaalsContact C-N 3.35Å; E12-T14 PolarHBondContact O-N 3.45Å; T14-L16 VanDerWaalsContact C-N 3.33Å; T14-L16 PolarHBondContact O-N 2.91Å; T14-R17 PolarHBondContact O-N 3.17Å; T14-L18 WeakPolarHBondContact O-CD1 3.32Å; T14-L18 PolarHBondContact O-N 3.31Å
15L98.8Very high98.3Very high102 Ų102106 Ų10653%0.53452%0.519SS..Hα-helixtrans-63.1-39.7177.5-75.2171.1000111.8E11 E12 L18 K19E11-L15 HydrophobicContact CG-CD1 4.27Å; E11-L15 WeakPolarHBondContact O-CG 3.33Å; E11-L15 PolarHBondContact O-N 2.79Å; E12-L15 PolarHBondContact O-N 3.33Å; L15-L18 PolarHBondContact O-N 3.37Å; L15-K19 VanDerWaalsContact O-CB 3.26Å; L15-K19 WeakPolarHBondContact O-CB 3.49Å; L15-K19 PolarHBondContact O-N 3.46Å
16L98.7Very high98.4Very high103 Ų103106.7 Ų106.754%0.53952%0.523SS..Hα-helixtrans-62.7-42.2175.1-74.1172.6000111.8E12 E13 T14 K19 A20E12-L16 HydrophobicContact CG-CD1 4.37Å; E12-L16 WeakPolarHBondContact O-CG 3.38Å; E12-L16 PolarHBondContact O-N 2.89Å; E13-L16 PolarHBondContact O-N 2.96Å; T14-L16 VanDerWaalsContact C-N 3.33Å; T14-L16 PolarHBondContact O-N 2.91Å; L16-K19 PolarHBondContact O-N 3.34Å; L16-A20 PolarHBondContact O-N 3.46Å
17R98.6Very high98.4Very high154 Ų154105.3 Ų105.358%0.58152%0.519SS*.Hα-helixtrans-64.2-44.6175-65.8179-159.9178.43.5111.9E13 T14 A20 A21E13-R17 VanDerWaalsContact CD-NH2 3.33Å; E13-R17 WeakPolarHBondContact O-CG 3.38Å; E13-R17 PolarHBondContact O-N 2.89Å; E13-R17 VanDerWaalsContact O-N 3.12Å; E13-R17 IonicContact OE1-CZ 2.78Å; E13-R17 IonicContact OE1-NE 3.99Å; E13-R17 IonicContact OE1-NH2 3.58Å; E13-R17 PolarHBondContact OE1-NH2 2.74Å; E13-R17 IonicContact OE2-NH2 2.65Å; T14-R17 PolarHBondContact O-N 3.17Å; R17-A20 PolarHBondContact O-N 2.77Å; R17-A21 PolarHBondContact O-N 3.34Å
18L98.7Very high98.5Very high105 Ų105108.6 Ų108.655%0.5553%0.527SS..Hα-helixtrans-62.8-43.2177.3-93.674.1000111.3T14 L15 A20 A21 L22T14-L18 WeakPolarHBondContact O-CD1 3.32Å; T14-L18 PolarHBondContact O-N 3.31Å; L15-L18 PolarHBondContact O-N 3.37Å; L18-A20 VanDerWaalsContact C-N 3.33Å; L18-A20 PolarHBondContact O-N 3.24Å; L18-A21 PolarHBondContact O-N 3.31Å; L18-L22 WeakPolarHBondContact O-CB 3.33Å; L18-L22 WeakPolarHBondContact O-CG 3.36Å; L18-L22 PolarHBondContact O-N 3.35Å
19K98.6Very high98.5Very high149 Ų149109.7 Ų109.765%0.64853%0.532SS*.Hα-helixtrans-59.2-44.6176.5-178.7-178177.5-177.20111.5L15 L16 L22 H23L15-K19 VanDerWaalsContact O-CB 3.26Å; L15-K19 WeakPolarHBondContact O-CB 3.49Å; L15-K19 PolarHBondContact O-N 3.46Å; L16-K19 PolarHBondContact O-N 3.34Å; K19-L22 PolarHBondContact O-N 3.45Å; K19-H23 WeakPolarHBondContact O-CB 3.45Å; K19-H23 PolarHBondContact O-N 3.17Å
20A98.7Very high98.6Very high53 Ų53108.5 Ų108.544%0.43853%0.532SS..Hα-helixtrans-62.5-47.9176.600000111.4L16 R17 L18 L22 H23 D24L16-A20 PolarHBondContact O-N 3.46Å; R17-A20 PolarHBondContact O-N 2.77Å; L18-A20 VanDerWaalsContact C-N 3.33Å; L18-A20 PolarHBondContact O-N 3.24Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 2.95Å; A20-H23 PolarHBondContact O-N 3.48Å; A20-D24 PolarHBondContact O-N 3.05Å
21A98.6Very high98.6Very high51 Ų51106.5 Ų106.542%0.42153%0.531SS..Hα-helixtrans-60.2-41.6178.300000112.8R17 L18 D24 Q25R17-A21 PolarHBondContact O-N 3.34Å; L18-A21 PolarHBondContact O-N 3.31Å; A21-D24 PolarHBondContact O-N 2.96Å; A21-Q25 WeakPolarHBondContact O-CG 3.33Å; A21-Q25 PolarHBondContact O-N 3.07Å
22L98.8Very high98.6Very high109 Ų109105.2 Ų105.257%0.57153%0.525SS*.Hα-helixtrans-66.3-40.1176-75169.5000112.2L18 K19 A20 Q25 L26L18-L22 WeakPolarHBondContact O-CB 3.33Å; L18-L22 WeakPolarHBondContact O-CG 3.36Å; L18-L22 PolarHBondContact O-N 3.35Å; K19-L22 PolarHBondContact O-N 3.45Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 2.95Å; L22-Q25 PolarHBondContact O-N 2.96Å; L22-L26 WeakPolarHBondContact O-CB 3.45Å; L22-L26 PolarHBondContact O-N 3.45Å
23H98.7Very high98.6Very high107 Ų107104.7 Ų104.750%0.49552%0.522SS..Hα-helixtrans-63.3-43177-169.565.7000111.5K19 A20 L26 N27K19-H23 WeakPolarHBondContact O-CB 3.45Å; K19-H23 PolarHBondContact O-N 3.17Å; A20-H23 PolarHBondContact O-N 3.48Å; H23-L26 PolarHBondContact O-N 3.42Å; H23-N27 PolarHBondContact CD2-ND2 2.99Å; H23-N27 VanDerWaalsContact CD2-ND2 3.26Å; H23-N27 PolarHBondContact NE2-ND2 2.82Å; H23-N27 VanDerWaalsContact NE2-ND2 3.15Å; H23-N27 WeakPolarHBondContact O-CB 3.46Å; H23-N27 VanDerWaalsContact O-CG 3.26Å; H23-N27 PolarHBondContact O-N 3.01Å; H23-N27 PolarHBondContact O-ND2 3.29Å
24D98.7Very high98.6Very high108 Ų108104.1 Ų104.158%0.57852%0.522SS*.Hα-helixtrans-63.4-43.8175.7-80.59.9000112.2A20 A21 L26 N27 R28A20-D24 PolarHBondContact O-N 3.05Å; A21-D24 PolarHBondContact O-N 2.96Å; D24-L26 VanDerWaalsContact C-N 3.35Å; D24-L26 PolarHBondContact O-N 3.42Å; D24-N27 PolarHBondContact O-N 3.41Å; D24-R28 WeakPolarHBondContact O-CB 3.33Å; D24-R28 PolarHBondContact O-N 3.15Å
25Q98.8Very high98.6Very high123 Ų123103.3 Ų103.358%0.57552%0.522SS*.Hα-helixtrans-61.1-43.1176-76.5179.8-15.900112.1A21 L22 R28 L29A21-Q25 WeakPolarHBondContact O-CG 3.33Å; A21-Q25 PolarHBondContact O-N 3.07Å; L22-Q25 PolarHBondContact O-N 2.96Å; Q25-R28 PolarHBondContact O-N 3.24Å; Q25-L29 WeakPolarHBondContact O-CG 3.35Å; Q25-L29 PolarHBondContact O-N 3.41Å
26L98.8Very high98.5Very high112 Ų112103.1 Ų103.159%0.58652%0.521SS*.Hα-helixtrans-64.1-43177.3-176.863.5000111.6L22 H23 D24 R28 L29 K30L22-L26 WeakPolarHBondContact O-CB 3.45Å; L22-L26 PolarHBondContact O-N 3.45Å; H23-L26 PolarHBondContact O-N 3.42Å; D24-L26 VanDerWaalsContact C-N 3.35Å; D24-L26 PolarHBondContact O-N 3.42Å; L26-R28 VanDerWaalsContact C-N 3.34Å; L26-R28 PolarHBondContact O-N 2.92Å; L26-L29 PolarHBondContact O-N 3.33Å; L26-K30 WeakPolarHBondContact O-CB 3.39Å; L26-K30 PolarHBondContact O-N 2.86Å
27N98.6Very high98.5Very high68 Ų68103.2 Ų103.236%0.36452%0.519SS..Hα-helixtrans-62-43.1176.8-73.6-28.2000111.4H23 D24 K30 V31H23-N27 PolarHBondContact CD2-ND2 2.99Å; H23-N27 VanDerWaalsContact CD2-ND2 3.26Å; H23-N27 PolarHBondContact NE2-ND2 2.82Å; H23-N27 VanDerWaalsContact NE2-ND2 3.15Å; H23-N27 WeakPolarHBondContact O-CB 3.46Å; H23-N27 VanDerWaalsContact O-CG 3.26Å; H23-N27 PolarHBondContact O-N 3.01Å; H23-N27 PolarHBondContact O-ND2 3.29Å; D24-N27 PolarHBondContact O-N 3.41Å; N27-K30 PolarHBondContact O-N 2.83Å; N27-V31 WeakPolarHBondContact O-CG2 3.48Å; N27-V31 PolarHBondContact O-N 3.47Å; N27-V31 VanDerWaalsContact O-N 3.1Å
28R98.6Very high98.3Very high171 Ų17199.1 Ų99.165%0.64551%0.514SS*.Hα-helixtrans-60.2-49.9175.3179.7-178.6166.1-148.6-11.6111.8D24 Q25 L26 K30 V31 E32D24-R28 WeakPolarHBondContact O-CB 3.33Å; D24-R28 PolarHBondContact O-N 3.15Å; Q25-R28 PolarHBondContact O-N 3.24Å; L26-R28 VanDerWaalsContact C-N 3.34Å; L26-R28 PolarHBondContact O-N 2.92Å; R28-K30 VanDerWaalsContact C-N 3.29Å; R28-K30 PolarHBondContact O-N 3.03Å; R28-V31 PolarHBondContact O-N 2.95Å; R28-V31 VanDerWaalsContact O-N 3.15Å; R28-E32 IonicContact CZ-OE1 3.21Å; R28-E32 IonicContact NE-OE1 3.58Å; R28-E32 PolarHBondContact NE-OE1 2.84Å; R28-E32 IonicContact NH2-OE1 2.84Å; R28-E32 PolarHBondContact NH2-OE1 3.26Å; R28-E32 PolarHBondContact O-N 2.95Å
29L98.7Very high98.1Very high107 Ų10799.6 Ų99.656%0.5652%0.515SS*.Hα-helixtrans-59.7-40.1179.1-77.4170.3000112.1Q25 L26 V31 E32 E33Q25-L29 WeakPolarHBondContact O-CG 3.35Å; Q25-L29 PolarHBondContact O-N 3.41Å; L26-L29 PolarHBondContact O-N 3.33Å; L29-V31 VanDerWaalsContact C-N 3.34Å; L29-V31 PolarHBondContact O-N 3.18Å; L29-E32 PolarHBondContact O-N 3.42Å; L29-E33 WeakPolarHBondContact O-CB 3.42Å; L29-E33 PolarHBondContact O-N 2.78Å
30K98.7Very high97.9Very high128 Ų12897.7 Ų97.756%0.55751%0.511SS*.Hα-helixtrans-62.2-40.8176-176.4177.1-1801790112.4L26 N27 R28 E33 L34L26-K30 WeakPolarHBondContact O-CB 3.39Å; L26-K30 PolarHBondContact O-N 2.86Å; N27-K30 PolarHBondContact O-N 2.83Å; R28-K30 VanDerWaalsContact C-N 3.29Å; R28-K30 PolarHBondContact O-N 3.03Å; K30-E33 PolarHBondContact O-N 3.3Å; K30-L34 HydrophobicContact CG-CD1 4.4Å; K30-L34 WeakPolarHBondContact O-CG 3.41Å; K30-L34 PolarHBondContact O-N 3.48Å
31V98.6Very high97.7Very high100 Ų10098.6 Ų98.661%0.60651%0.513SS*.Hα-helixtrans-65.4-43.3176.3171.50000110.9N27 R28 L29 L34 A35N27-V31 WeakPolarHBondContact O-CG2 3.48Å; N27-V31 PolarHBondContact O-N 3.47Å; N27-V31 VanDerWaalsContact O-N 3.1Å; R28-V31 PolarHBondContact O-N 2.95Å; R28-V31 VanDerWaalsContact O-N 3.15Å; L29-V31 VanDerWaalsContact C-N 3.34Å; L29-V31 PolarHBondContact O-N 3.18Å; V31-L34 PolarHBondContact O-N 2.88Å; V31-A35 WeakPolarHBondContact O-CB 3.42Å; V31-A35 PolarHBondContact O-N 3.38Å
32E98.4Very high97.2Very high77 Ų7799.8 Ų99.836%0.3652%0.519SS..Hα-helixtrans-63-41.4176.8-70177.2-170.100111.8R28 L29 A35 L36R28-E32 IonicContact CZ-OE1 3.21Å; R28-E32 IonicContact NE-OE1 3.58Å; R28-E32 PolarHBondContact NE-OE1 2.84Å; R28-E32 IonicContact NH2-OE1 2.84Å; R28-E32 PolarHBondContact NH2-OE1 3.26Å; R28-E32 PolarHBondContact O-N 2.95Å; L29-E32 PolarHBondContact O-N 3.42Å; E32-A35 PolarHBondContact O-N 2.74Å; E32-L36 WeakPolarHBondContact O-CG 3.15Å; E32-L36 PolarHBondContact O-N 2.97Å
33E98.2Very high96.7Very high107 Ų107102.5 Ų102.550%0.552%0.522SS..Hα-helixtrans-63.1-46.1176.6-174.3-106.8158.700112.2L29 K30 A35 L36 Q37L29-E33 WeakPolarHBondContact O-CB 3.42Å; L29-E33 PolarHBondContact O-N 2.78Å; K30-E33 PolarHBondContact O-N 3.3Å; E33-A35 VanDerWaalsContact C-N 3.32Å; E33-A35 PolarHBondContact O-N 2.98Å; E33-L36 PolarHBondContact O-N 3.02Å; E33-Q37 WeakPolarHBondContact O-CB 3.35Å; E33-Q37 PolarHBondContact O-N 3.37Å
34L98.2Very high95.8Very high86 Ų86106.1 Ų106.145%0.4553%0.531SS..Hα-helixtrans-62.5-38.2174.8-71.6172.9000112.3K30 V31 Q37 S38K30-L34 HydrophobicContact CG-CD1 4.4Å; K30-L34 WeakPolarHBondContact O-CG 3.41Å; K30-L34 PolarHBondContact O-N 3.48Å; V31-L34 PolarHBondContact O-N 2.88Å; L34-Q37 PolarHBondContact O-N 3.45Å; L34-S38 WeakPolarHBondContact O-CB 3.43Å; L34-S38 PolarHBondContact O-N 3.03Å
35A97.6Very high94.3Very high49 Ų49102.6 Ų102.641%0.40552%0.52SS..Hα-helixtrans-64.1-44.6175.700000111.4V31 E32 E33 S38 M39V31-A35 WeakPolarHBondContact O-CB 3.42Å; V31-A35 PolarHBondContact O-N 3.38Å; E32-A35 PolarHBondContact O-N 2.74Å; E33-A35 VanDerWaalsContact C-N 3.32Å; E33-A35 PolarHBondContact O-N 2.98Å; A35-S38 WeakPolarHBondContact O-CB 3.36Å; A35-S38 PolarHBondContact O-N 3.3Å; A35-M39 WeakPolarHBondContact O-CG 3.43Å; A35-M39 PolarHBondContact O-N 3.39Å
36L98Very high92.6Very high99 Ų99102 Ų10252%0.51852%0.521SS..Hα-helixtrans-63-45.7175.4-71.1164.3000111.7E32 E33 S38 M39 I40E32-L36 WeakPolarHBondContact O-CG 3.15Å; E32-L36 PolarHBondContact O-N 2.97Å; E33-L36 PolarHBondContact O-N 3.02Å; L36-S38 VanDerWaalsContact C-N 3.29Å; L36-S38 PolarHBondContact O-N 3.47Å; L36-M39 HydrophobicContact CB-CE 4.47Å; L36-M39 HydrophobicContact CD2-CE 3.55Å; L36-M39 HydrophobicContact CG-CE 4.17Å; L36-M39 PolarHBondContact O-N 3.15Å; L36-I40 WeakPolarHBondContact O-CG1 3.26Å; L36-I40 PolarHBondContact O-N 2.96Å
37Q96.9Very high90.7Very high104 Ų104102 Ų10249%0.48652%0.518SS..Hα-helixtrans-59.2-42.4175.9-172.6-178.337.700111.2E33 L34 I40 S41E33-Q37 WeakPolarHBondContact O-CB 3.35Å; E33-Q37 PolarHBondContact O-N 3.37Å; L34-Q37 PolarHBondContact O-N 3.45Å; Q37-I40 PolarHBondContact O-N 3.01Å; Q37-S41 VanDerWaalsContact O-CB 3.32Å; Q37-S41 WeakPolarHBondContact O-CB 3.42Å; Q37-S41 PolarHBondContact O-N 3.47Å; Q37-S41 PolarHBondContact O-OG 2.93Å
38S95.6Very high88.8Confident69 Ų69105 Ų10548%0.48353%0.531SS..Hα-helixtrans-60.8-47.5174.8-172.30000111L34 A35 L36 I40 S41 S42L34-S38 WeakPolarHBondContact O-CB 3.43Å; L34-S38 PolarHBondContact O-N 3.03Å; A35-S38 WeakPolarHBondContact O-CB 3.36Å; A35-S38 PolarHBondContact O-N 3.3Å; L36-S38 VanDerWaalsContact C-N 3.29Å; L36-S38 PolarHBondContact O-N 3.47Å; S38-I40 VanDerWaalsContact C-N 3.35Å; S38-I40 PolarHBondContact O-N 3.41Å; S38-S41 PolarHBondContact O-N 3.49Å; S38-S42 WeakPolarHBondContact O-CB 3.48Å; S38-S42 PolarHBondContact O-N 2.96Å; S38-S42 PolarHBondContact O-OG 3.1Å
39M95.2Very high86.6Confident114 Ų114102.2 Ų102.256%0.56253%0.528SS*.Hα-helixtrans-61.5-41.9179.5-71.9-174-64.600112.3A35 L36 R43A35-M39 WeakPolarHBondContact O-CG 3.43Å; A35-M39 PolarHBondContact O-N 3.39Å; L36-M39 HydrophobicContact CB-CE 4.47Å; L36-M39 HydrophobicContact CD2-CE 3.55Å; L36-M39 HydrophobicContact CG-CE 4.17Å; L36-M39 PolarHBondContact O-N 3.15Å; M39-R43 WeakPolarHBondContact O-CB 3.35Å; M39-R43 PolarHBondContact O-N 2.96Å
40I94.2Very high84.4Confident110 Ų110101.1 Ų101.156%0.56453%0.53SS*.Hα-helixtrans-65.3-43176.8-66.4165.9000110.6L36 Q37 S38 R43 R44L36-I40 WeakPolarHBondContact O-CG1 3.26Å; L36-I40 PolarHBondContact O-N 2.96Å; Q37-I40 PolarHBondContact O-N 3.01Å; S38-I40 VanDerWaalsContact C-N 3.35Å; S38-I40 PolarHBondContact O-N 3.41Å; I40-R43 PolarHBondContact O-N 3.3Å; I40-R44 WeakPolarHBondContact O-CB 3.49Å; I40-R44 PolarHBondContact O-N 3.38Å
41S93.2Very high82.2Confident71 Ų7198.8 Ų98.850%0.49753%0.53SS..Hα-helixtrans-67.2-41.4179.9-56.20000111.6Q37 S38 R44 G45Q37-S41 VanDerWaalsContact O-CB 3.32Å; Q37-S41 WeakPolarHBondContact O-CB 3.42Å; Q37-S41 PolarHBondContact O-N 3.47Å; Q37-S41 PolarHBondContact O-OG 2.93Å; S38-S41 PolarHBondContact O-N 3.49Å; S41-R44 PolarHBondContact O-N 3.22Å; S41-G45 PolarHBondContact O-N 3.37Å; S41-G45 VanDerWaalsContact O-N 3.15Å
42S89.7Confident79.9Confident77 Ų77101.1 Ų101.154%0.53853%0.534SS..Hα-helixtrans-60.8-45.8174.1-65.90000111.3S38 R44 G45 D46S38-S42 WeakPolarHBondContact O-CB 3.48Å; S38-S42 PolarHBondContact O-N 2.96Å; S38-S42 PolarHBondContact O-OG 3.1Å; S42-R44 PolarHBondContact O-N 3.32Å; S42-G45 PolarHBondContact O-N 3.37Å; S42-D46 PolarHBondContact O-N 3.47Å
43R86.8Confident77Confident166 Ų166102.4 Ų102.463%0.62655%0.547SS*.Hα-helixtrans-64.2-40.2179-174.4174.2173.9-140.2-15112.7M39 I40 G45 D46 E47M39-R43 WeakPolarHBondContact O-CB 3.35Å; M39-R43 PolarHBondContact O-N 2.96Å; I40-R43 PolarHBondContact O-N 3.3Å; R43-G45 VanDerWaalsContact C-N 3.31Å; R43-G45 PolarHBondContact O-N 3.45Å; R43-D46 PolarHBondContact O-N 2.9Å; R43-E47 IonicContact CZ-OE1 3.38Å; R43-E47 IonicContact NE-OE1 3.35Å; R43-E47 PolarHBondContact NE-OE1 3.18Å; R43-E47 IonicContact NH2-OE1 2.79Å; R43-E47 PolarHBondContact NH2-OE1 3.5Å; R43-E47 PolarHBondContact O-N 2.96Å
44R79.5Confident74.2Confident183 Ų183102.4 Ų102.469%0.69155%0.554SS**Hα-helixtrans-64.3-35.8177.3-173.5178.9-72.1-111-0.7112.2I40 S41 S42 M48I40-R44 WeakPolarHBondContact O-CB 3.49Å; I40-R44 PolarHBondContact O-N 3.38Å; S41-R44 PolarHBondContact O-N 3.22Å; S42-R44 PolarHBondContact O-N 3.32Å; R44-M48 PolarHBondContact O-N 3.02Å
45G68.2Low71.6Confident34 Ų34103.7 Ų103.735%0.35157%0.568SS.*Hα-helixtrans-66.8-39.3172.200000112.5S41 S42 R43 M48 L49S41-G45 PolarHBondContact O-N 3.37Å; S41-G45 VanDerWaalsContact O-N 3.15Å; S42-G45 PolarHBondContact O-N 3.37Å; R43-G45 VanDerWaalsContact C-N 3.31Å; R43-G45 PolarHBondContact O-N 3.45Å; G45-M48 PolarHBondContact O-N 3.15Å; G45-L49 WeakPolarHBondContact O-CG 3.38Å; G45-L49 PolarHBondContact O-N 2.99Å
46D62.7Low69.1Low111 Ų111110.6 Ų110.659%0.59459%0.591SS**Hα-helixtrans-71.8-34.7-179-140.218.3000112.7S42 R43 M48 L49 S50S42-D46 PolarHBondContact O-N 3.47Å; R43-D46 PolarHBondContact O-N 2.9Å; D46-M48 VanDerWaalsContact C-N 3.32Å; D46-M48 PolarHBondContact O-N 3.26Å; D46-L49 PolarHBondContact O-N 3.34Å; D46-S50 WeakPolarHBondContact O-CB 3.42Å; D46-S50 PolarHBondContact O-N 2.86Å
47E59.8Low66.5Low110 Ų110115.2 Ų115.251%0.51461%0.61SS.*Hα-helixtrans-63.9-36.6171.9-91.5160-172.500112R43 S51R43-E47 IonicContact CZ-OE1 3.38Å; R43-E47 IonicContact NE-OE1 3.35Å; R43-E47 PolarHBondContact NE-OE1 3.18Å; R43-E47 IonicContact NH2-OE1 2.79Å; R43-E47 PolarHBondContact NH2-OE1 3.5Å; R43-E47 PolarHBondContact O-N 2.96Å; E47-S51 PolarHBondContact O-N 2.97Å
48M57.7Low64.1Low133 Ų133114.8 Ų114.866%0.65562%0.619SS**Hα-helixtrans-67.1-41.4172.3-74.1-175.2141.100111.8R44 G45 D46 S51 H52R44-M48 PolarHBondContact O-N 3.02Å; G45-M48 PolarHBondContact O-N 3.15Å; D46-M48 VanDerWaalsContact C-N 3.32Å; D46-M48 PolarHBondContact O-N 3.26Å; M48-S51 PolarHBondContact O-OG 2.68Å; M48-H52 PolarHBondContact O-CD2 3.45Å
49L53.3Low61.9Low111 Ų111119.7 Ų119.758%0.58163%0.634SS**Hα-helixtrans-77.7-36.4-178.3-65.5175.5000113.4G45 D46 S51 H52 T53G45-L49 WeakPolarHBondContact O-CG 3.38Å; G45-L49 PolarHBondContact O-N 2.99Å; D46-L49 PolarHBondContact O-N 3.34Å; L49-S51 PolarHBondContact O-N 3.25Å; L49-H52 WeakPolarHBondContact O-CA 3.47Å; L49-H52 PolarHBondContact O-N 3.41Å; L49-T53 PolarHBondContact O-N 2.91Å
50S53Low59.8Low84 Ų84122 Ų12259%0.58765%0.649SS**Hα-helixtrans-66.4-26.2176.4-173.60000111.9D46 H52D46-S50 WeakPolarHBondContact O-CB 3.42Å; D46-S50 PolarHBondContact O-N 2.86Å; S50-H52 PolarHBondContact O-N 3.22Å
51S50.8Low57.8Low80 Ų80125 Ų12556%0.55966%0.662SS**THydrogen-bonded Turntrans-71.1-11.2169.371.90000113.9E47 M48 L49E47-S51 PolarHBondContact O-N 2.97Å; M48-S51 PolarHBondContact O-OG 2.68Å; L49-S51 PolarHBondContact O-N 3.25Å
52H50.9Low56Low148 Ų148127.9 Ų127.969%0.68567%0.672SS**THydrogen-bonded Turntrans-113.3-4.1-174.6-66.3-41000114.9M48 L49 S50M48-H52 PolarHBondContact O-CD2 3.45Å; L49-H52 WeakPolarHBondContact O-CA 3.47Å; L49-H52 PolarHBondContact O-N 3.41Å; S50-H52 PolarHBondContact O-N 3.22Å
53T37.7Very low54.7Low104 Ų104129.1 Ų129.164%0.63868%0.676SS**  trans-125.871.3-178.665.10000112.7L49L49-T53 PolarHBondContact O-N 2.91Å
54V39.2Very low53.6Low107 Ų107127 Ų12765%0.64867%0.672SS**SBendtrans-134.4122.2149.8-174.90000107.1
55P43.4Very low53.2Low114 Ų114124.2 Ų124.274%0.7468%0.676SS**  trans-67.4145.6-166.428.9-34.2000111Q57P55-Q57 PolarHBondContact O-N 2.83Å
56E44.6Very low53.5Low193 Ų193129.3 Ų129.390%0.90270%0.695SS**SBendtrans-36.592.9172.5-65.1177.7124.900113.2
57Q44.5Very low54.3Low196 Ų196127 Ų12792%0.91668%0.683SS**SBendtrans-174.77.7144.4-114.7175.222.400117P55P55-Q57 PolarHBondContact O-N 2.83Å
58S46.5Very low55.3Low96 Ų96129 Ų12967%0.67169%0.692SS**  trans-140.150.6172.949.70000111.6D60S58-D60 VanDerWaalsContact C-N 3.33Å; S58-D60 PolarHBondContact O-N 3.45Å
59H49.6Very low56.5Low171 Ų171125 Ų12579%0.79268%0.68SS**G310 helixtrans-81.4-3.3-174.6-160.958.8000114.6M61H59-M61 PolarHBondContact O-N 3.37Å
60D50Low57.7Low163 Ų163121.6 Ų121.687%0.87267%0.666SS**G310 helixtrans-83.7-3.1-173.6-105.2-4.6000115.5S58S58-D60 VanDerWaalsContact C-N 3.33Å; S58-D60 PolarHBondContact O-N 3.45Å
61M52.9Low59Low173 Ų173122 Ų12285%0.85266%0.66SS**G310 helixtrans-128.28.2-175.8-75.9-173.4-83.300115.4H59 V63H59-M61 PolarHBondContact O-N 3.37Å; M61-V63 PolarHBondContact O-N 2.95Å
62L55.5Low60.5Low132 Ų132124 Ų12469%0.69166%0.664SS**  trans-85.957173.5-141.2134.1000109.9H64L62-H64 PolarHBondContact O-N 3.44Å
63V61.8Low62.1Low103 Ų103124 Ų12462%0.62467%0.665SS**  trans-62.9104.8174.4-175.90000106.7M61 V65M61-V63 PolarHBondContact O-N 2.95Å; V63-V65 PolarHBondContact O-N 2.92Å
64H64.1Low64Low120 Ų120124.6 Ų124.656%0.55667%0.668SS**  trans-56.5102.2176.3-174.7-69.8000108.9L62 D66 N67L62-H64 PolarHBondContact O-N 3.44Å; H64-D66 PolarHBondContact CE1-O 2.65Å; H64-D66 VanDerWaalsContact ND1-C 3.28Å; H64-D66 PolarHBondContact O-N 3.12Å; H64-N67 HydrophobicContact CB-CB 4.05Å; H64-N67 WeakPolarHBondContact ND1-CB 3.39Å; H64-N67 PolarHBondContact ND1-N 2.89Å; H64-N67 WeakPolarHBondContact O-CB 3.35Å; H64-N67 PolarHBondContact O-N 3.37Å; H64-N67 VanDerWaalsContact O-N 3.16Å
65V71.8Confident66.2Low125 Ų125125.4 Ų125.476%0.75867%0.674SS**THydrogen-bonded Turntrans-62-30.7-169.8-114.90000112.5V63V63-V65 PolarHBondContact O-N 2.92Å
66D73.6Confident68.2Low141 Ų141126.8 Ų126.875%0.75468%0.675SS**THydrogen-bonded Turntrans-103.130.2180-67.3-26000112.7H64H64-D66 PolarHBondContact CE1-O 2.65Å; H64-D66 VanDerWaalsContact ND1-C 3.28Å; H64-D66 PolarHBondContact O-N 3.12Å
67N80.6Confident70.2Confident63 Ų63126 Ų12634%0.33767%0.671SS.*  trans-89.6112.8174.1-175.442.8000109.2H64 A69 S70 I71H64-N67 HydrophobicContact CB-CB 4.05Å; H64-N67 WeakPolarHBondContact ND1-CB 3.39Å; H64-N67 PolarHBondContact ND1-N 2.89Å; H64-N67 WeakPolarHBondContact O-CB 3.35Å; H64-N67 PolarHBondContact O-N 3.37Å; H64-N67 VanDerWaalsContact O-N 3.16Å; N67-A69 PolarHBondContact O-N 3.09Å; N67-S70 WeakPolarHBondContact CB-OG 3.32Å; N67-S70 PolarHBondContact ND2-N 3.15Å; N67-S70 PolarHBondContact ND2-OG 3.39Å; N67-S70 WeakPolarHBondContact O-CB 3.43Å; N67-S70 PolarHBondContact O-N 3.29Å; N67-I71 PolarHBondContact O-N 3.1Å; N67-I71 VanDerWaalsContact O-N 3.07Å
68E79.8Confident72Confident151 Ų151123.2 Ų123.271%0.70666%0.662SS**Hα-helixtrans-51.4-41.8179.3-175.5179.9-178.800111.8S70 I71 N72E68-S70 PolarHBondContact O-N 3.38Å; E68-I71 PolarHBondContact O-N 3.34Å; E68-N72 PolarHBondContact O-N 2.86Å; E68-N72 PolarHBondContact O-ND2 3.44Å
69A82.4Confident73.5Confident50 Ų50124.3 Ų124.341%0.41367%0.669SS.*Hα-helixtrans-66.5-34178.200000113.1N67 Q73N67-A69 PolarHBondContact O-N 3.09Å; A69-Q73 VanDerWaalsContact O-CG 3.3Å; A69-Q73 WeakPolarHBondContact O-CG 3.43Å; A69-Q73 PolarHBondContact O-N 3.36Å
70S79.7Confident74.7Confident40 Ų40122.7 Ų122.728%0.2867%0.671SS.*Hα-helixtrans-72.2-38.6177.6-600000111.8N67 E68 N72 Q73N67-S70 WeakPolarHBondContact CB-OG 3.32Å; N67-S70 PolarHBondContact ND2-N 3.15Å; N67-S70 PolarHBondContact ND2-OG 3.39Å; N67-S70 WeakPolarHBondContact O-CB 3.43Å; N67-S70 PolarHBondContact O-N 3.29Å; E68-S70 PolarHBondContact O-N 3.38Å; S70-N72 VanDerWaalsContact C-N 3.32Å; S70-N72 PolarHBondContact O-N 3Å; S70-Q73 PolarHBondContact O-N 2.9Å
71I79.4Confident75.7Confident92 Ų92124.3 Ų124.347%0.47267%0.671SS.*Hα-helixtrans-61.6-44177.4-66169.3000110.1N67 E68 Q73 T74N67-I71 PolarHBondContact O-N 3.1Å; N67-I71 VanDerWaalsContact O-N 3.07Å; E68-I71 PolarHBondContact O-N 3.34Å; I71-Q73 PolarHBondContact O-N 3.03Å; I71-T74 PolarHBondContact O-N 3.14Å; I71-T74 PolarHBondContact O-OG1 3.44Å
72N83.5Confident75.9Confident121 Ų121120.4 Ų120.465%0.64766%0.66SS**THydrogen-bonded Turntrans-71.5-14.2-178.5-70.3-26.9000114.4E68 S70E68-N72 PolarHBondContact O-N 2.86Å; E68-N72 PolarHBondContact O-ND2 3.44Å; S70-N72 VanDerWaalsContact C-N 3.32Å; S70-N72 PolarHBondContact O-N 3Å
73Q82.7Confident75.9Confident149 Ų149119.2 Ų119.270%0.69665%0.651SS**THydrogen-bonded Turntrans-89.2-1.6177.3-73.2176.216.800113.3A69 S70 I71 T75A69-Q73 VanDerWaalsContact O-CG 3.3Å; A69-Q73 WeakPolarHBondContact O-CG 3.43Å; A69-Q73 PolarHBondContact O-N 3.36Å; S70-Q73 PolarHBondContact O-N 2.9Å; I71-Q73 PolarHBondContact O-N 3.03Å; Q73-T75 PolarHBondContact O-N 2.99Å; Q73-T75 VanDerWaalsContact O-N 3.09Å
74T79.6Confident75.6Confident116 Ų116120 Ų12071%0.71266%0.655SS**  trans-66111.8178.154.10000110.5I71I71-T74 PolarHBondContact O-N 3.14Å; I71-T74 PolarHBondContact O-OG1 3.44Å
75T84.2Confident75.1Confident125 Ų125120.8 Ų120.877%0.76767%0.669SS**  trans-91.5120.9177.8-58.10000108.7Q73 E77Q73-T75 PolarHBondContact O-N 2.99Å; Q73-T75 VanDerWaalsContact O-N 3.09Å; T75-E77 PolarHBondContact O-N 3.12Å
76L85.7Confident74.1Confident143 Ų143122.2 Ų122.275%0.74967%0.667SS**  trans-84.3112-179.5-172.270.4000110.2L78L76-L78 HydrophobicContact CD1-CD2 4.32Å; L76-L78 HydrophobicContact CD2-CD1 3.93Å; L76-L78 HydrophobicContact CD2-CD2 3.96Å; L76-L78 HydrophobicContact CD2-CG 3.92Å; L76-L78 HydrophobicContact CG-CD1 4.49Å; L76-L78 HydrophobicContact CG-CD2 3.93Å; L76-L78 HydrophobicContact CG-CG 3.95Å
77E86.8Confident73.1Confident176 Ų176123.9 Ų123.982%0.82267%0.671SS**  trans-91.4102174.2-66.5-176.5-175.100110.2T75T75-E77 PolarHBondContact O-N 3.12Å
78L81.4Confident71.7Confident138 Ų138129.9 Ų129.972%0.72370%0.697SS**  trans-99.2107.6173.8-61178.9000109.2L76L76-L78 HydrophobicContact CD1-CD2 4.32Å; L76-L78 HydrophobicContact CD2-CD1 3.93Å; L76-L78 HydrophobicContact CD2-CD2 3.96Å; L76-L78 HydrophobicContact CD2-CG 3.92Å; L76-L78 HydrophobicContact CG-CD1 4.49Å; L76-L78 HydrophobicContact CG-CD2 3.93Å; L76-L78 HydrophobicContact CG-CG 3.95Å
79S79.3Confident70.1Confident118 Ų118131.7 Ų131.783%0.82571%0.705SS**  trans-84.6115.1169-71.20000109.4K81S79-K81 PolarHBondContact O-N 3.45Å; S79-K81 VanDerWaalsContact O-N 3.12Å
80T74Confident68.4Low137 Ų137138.5 Ų138.584%0.8473%0.728SS**  trans-76.195.5164.247.70000107.5S82T80-S82 PolarHBondContact O-N 3.16Å
81K70.7Confident66.9Low198 Ų198145.8 Ų145.886%0.86176%0.758SS**  trans-61.4109.8164.8-168.2173.2179.2-173.60105.4S79 H83S79-K81 PolarHBondContact O-N 3.45Å; S79-K81 VanDerWaalsContact O-N 3.12Å; K81-H83 VanDerWaalsContact C-N 3.35Å; K81-H83 PolarHBondContact O-N 3.31Å
82S57.4Low65.5Low90 Ų90150.1 Ų150.163%0.62978%0.776SS**  trans-57.3102.5176.858.90000107.2T80 V84T80-S82 PolarHBondContact O-N 3.16Å; S82-V84 PolarHBondContact O-N 3.2Å
83H55.7Low63.8Low108 Ų108153.5 Ų153.550%0.579%0.788SS.*  trans-67.171.8171.1178.4-55.3000107.6K81 E86K81-H83 VanDerWaalsContact C-N 3.35Å; K81-H83 PolarHBondContact O-N 3.31Å; H83-E86 IonicContact CD2-OE2 3.71Å; H83-E86 VanDerWaalsContact CE1-C 3.49Å; H83-E86 WeakPolarHBondContact CE1-CB 3.47Å; H83-E86 VanDerWaalsContact NE2-CB 3.27Å; H83-E86 WeakPolarHBondContact NE2-CB 3.47Å; H83-E86 IonicContact NE2-OE2 3.64Å
84V55.9Low62.1Low118 Ų118155.5 Ų155.572%0.71580%0.798SS**  trans-105.227.7176.5-178.90000108.8S82S82-V84 PolarHBondContact O-N 3.2Å
85T52.9Low60.5Low137 Ų137159 Ų15984%0.8481%0.806SS**SBendtrans-156.718.2-18030000115.7
86E51.7Low58.7Low156 Ų156159.2 Ų159.273%0.72981%0.813SS**SBendtrans-118.80.9171.6-98.9169.7-172.900112.8H83H83-E86 IonicContact CD2-OE2 3.71Å; H83-E86 VanDerWaalsContact CE1-C 3.49Å; H83-E86 WeakPolarHBondContact CE1-CB 3.47Å; H83-E86 VanDerWaalsContact NE2-CB 3.27Å; H83-E86 WeakPolarHBondContact NE2-CB 3.47Å; H83-E86 IonicContact NE2-OE2 3.64Å
87E51.8Low57.1Low175 Ų175160 Ų16082%0.81882%0.818SS**SBendtrans-92.29.4176.1-70.5-155.4162.200114.8
88E50.5Low55.6Low190 Ų190160.9 Ų160.989%0.88884%0.843SS**SBendtrans-1160179.9-73.1-164.4167.800116.1
89E46.6Very low54.3Low189 Ų189162 Ų16288%0.88385%0.849SS**SBendtrans-124.23.1-176.3-73.8-164.3168.700117.8
90E46.2Very low53Low193 Ų193164.3 Ų164.390%0.90285%0.85SS**SBendtrans-121.818.3175.1-72.1-166.6-177.400115.4E92E90-E92 VanDerWaalsContact C-N 3.3Å; E90-E92 PolarHBondContact O-N 3.13Å
91E49.7Very low51.8Low192 Ų192165.8 Ų165.890%0.89785%0.851SS**SBendtrans-9146.8160-74.4-162.8172.900111.5
92E50.2Low50.7Low184 Ų184163.9 Ų163.986%0.8685%0.85SS**SBendtrans-143.122.6172.3-83.1-153.6179.300115.9E90E90-E92 VanDerWaalsContact C-N 3.3Å; E90-E92 PolarHBondContact O-N 3.13Å
93E46.8Very low50.3Low192 Ų192168.6 Ų168.690%0.89786%0.864SS**  trans-143.550.9166.1-71.7-158.1-163.800114.3
94E46.3Very low49.9Very low191 Ų191172.6 Ų172.689%0.89389%0.888SS**  trans-110.464.9162.6-77.3-78.5-178.400109.5
95E46.9Very low49.5Very low189 Ų189176.5 Ų176.588%0.88390%0.9SS**  trans-164.274162-120.5-174.3-158.200112.4
96S47.3Very low49.2Very low130 Ų130179.5 Ų179.591%0.90991%0.905SS**  trans-162.288.6151-89.80000113
97D52Low49Very low160 Ų160181.5 Ų181.586%0.85692%0.92SS**  trans-43.5126.7163-16919.8000115.1
98S53.7Low48.8Very low193 Ų193182.1 Ų182.1100%1.3593%0.929SS**  trans-167.20155.4-77.50000112.7

Retrieved 98 of 98 residues in 249.2 ms (Link to these results)